tetrabutylazanium; tris(3-chloranyl-4-methyl-phenyl)-hexyl-boranuide

Systemtic Name: tetrabutylazanium; tris(3-chloranyl-4-methyl-phenyl)-hexyl-boranuide Openeye Name: tetrabutylammonium; tris(3-chloro-4-methyl-phenyl)-hexyl-boranuide CAS Name: tetrabutylammonium; tris(3-chloro-4-methylphenyl)-hexylboranuide IUPAC Name: tetrabutylazanium; tris(3-chloro-4-methylphenyl)-hexylboranuide Traditional Name: tetrabutylammonium; tris(3-chloro-4-methyl-phenyl)-hexyl-boranuide Formula: C43H67BCl3N MolecularWeight: 715.16878

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Descriptors Computed from Structure

Canonical SMILES:

[B-](CCCCCC)(C1=CC(=C(C=C1)C)Cl)(C2=CC(=C(C=C2)C)Cl)C3=CC(=C(C=C3)C)Cl.CCCC[N+](CCCC)(CCCC)CCCC

Isomeric SMILES

[B-](CCCCCC)(C1=CC(=C(C=C1)C)Cl)(C2=CC(=C(C=C2)C)Cl)C3=CC(=C(C=C3)C)Cl.CCCC[N+](CCCC)(CCCC)CCCC

InChI

InChI=1S/C27H31BCl3.C16H36N/c1-5-6-7-8-15-28(22-12-9-19(2)25(29)16-22,23-13-10-20(3)26(30)17-23)24-14-11-21(4)27(31)18-24;1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4/h9-14,16-18H,5-8,15H2,1-4H3;5-16H2,1-4H3/q-1;+1